Structure Information
Structure

Compound Identification

SMILES

NCCCC[C@H](N(C(=O)OCC1=CC=CC=C1)C(=O)C1=CC2=C(O1)C=CC1=C2OC(=O)C=C1)C(O)=O

InChIKey

InChIKey=MKNBSRHIVVUEPA-IBGZPJMESA-N

Formula

C26H24N2O8

Mass

492.484

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Coumarins and derivatives

Subclass

Furanocoumarins

Intermediate Tree Nodes

Not available

Direct Parent

Angular furanocoumarins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Angular furanocoumarin - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - 1-benzopyran - Benzopyran - Benzyloxycarbonyl - Benzofuran - Furoic acid or derivatives - Medium-chain fatty acid - Amino fatty acid - Heterocyclic fatty acid - Pyranone - Benzenoid - Monocyclic benzene moiety - Pyran - Fatty acid - Fatty acyl - Furan - Heteroaromatic compound - Carbamic acid ester - Amino acid - Lactone - Amino acid or derivatives - Carboxylic acid - Monocarboxylic acid or derivatives - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic nitrogen compound - Carbonyl group - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as angular furanocoumarins. These are furanocoumarins, with a structure characterized by a furan ring angularly fused to a coumarin.

External Descriptors

Not available

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